(3S)-3-(2-methoxy-4-methyl-phenoxy)pyrrolidin-1-ium

Systemtic Name: (3S)-3-(2-methoxy-4-methyl-phenoxy)pyrrolidin-1-ium Openeye Name: (3S)-3-(2-methoxy-4-methyl-phenoxy)pyrrolidin-1-ium CAS Name: (3S)-3-(2-methoxy-4-methylphenoxy)pyrrolidin-1-ium IUPAC Name: (3S)-3-(2-methoxy-4-methylphenoxy)pyrrolidin-1-ium Traditional Name: (3S)-3-(2-methoxy-4-methyl-phenoxy)pyrrolidin-1-ium Formula: C12H18NO2+ MolecularWeight: 208.27682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2CC[NH2+]C2)OC

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@H]2CC[NH2+]C2)OC

InChI

InChI=1S/C12H17NO2/c1-9-3-4-11(12(7-9)14-2)15-10-5-6-13-8-10/h3-4,7,10,13H,5-6,8H2,1-2H3/p+1/t10-/m0/s1